2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-yl-ethanone

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-yl-ethanone Openeye Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-naphthyl)ethanone CAS Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(2-naphthalenyl)ethanone IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-ylethanone Traditional Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(2-naphthyl)ethanone Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C23H21N3OS/c1-15-8-9-20(12-16(15)2)22-24-25-23(26(22)3)28-14-21(27)19-11-10-17-6-4-5-7-18(17)13-19/h4-13H,14H2,1-3H3